N-hydroxy-5-iodo-6-[(1-phenylcyclopropyl)amino]pyridine-3-carboxamide

C15H14IN3O2 — CID 145095862

IUPACN-hydroxy-5-iodo-6-[(1-phenylcyclopropyl)amino]pyridine-3-carboxamide
SMILESO=C(NO)c1cnc(NC2(c3ccccc3)CC2)c(I)c1
InChIInChI=1S/C15H14IN3O2/c16-12-8-10(14(20)19-21)9-17-13(12)18-15(6-7-15)11-4-2-1-3-5-11/h1-5,8-9,21H,6-7H2,(H,17,18)(H,19,20)
InChIKeyNGCMWDYSQMBVHO-UHFFFAOYSA-N
MW395.20 g/mol
LogP2.91
Rot. Bonds4

About N-hydroxy-5-iodo-6-[(1-phenylcyclopropyl)amino]pyridine-3-carboxamide

N-hydroxy-5-iodo-6-[(1-phenylcyclopropyl)amino]pyridine-3-carboxamide (PubChem CID 145095862) has the molecular formula C15H14IN3O2 and a molecular weight of 395.20 g/mol. Its IUPAC name is N-hydroxy-5-iodo-6-[(1-phenylcyclopropyl)amino]pyridine-3-carboxamide.

Molecular Properties

Compound NameN-hydroxy-5-iodo-6-[(1-phenylcyclopropyl)amino]pyridine-3-carboxamide
PubChem CID145095862
Molecular FormulaC15H14IN3O2
Molecular Weight395.20 g/mol
Exact Mass395.01
IUPAC NameN-hydroxy-5-iodo-6-[(1-phenylcyclopropyl)amino]pyridine-3-carboxamide
SMILESO=C(NO)c1cnc(NC2(c3ccccc3)CC2)c(I)c1
InChIInChI=1S/C15H14IN3O2/c16-12-8-10(14(20)19-21)9-17-13(12)18-15(6-7-15)11-4-2-1-3-5-11/h1-5,8-9,21H,6-7H2,(H,17,18)(H,19,20)
InChIKeyNGCMWDYSQMBVHO-UHFFFAOYSA-N
XLogP2.91
TPSA74.25 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500395.20
LogP ≤ 52.91
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydroxamic_acid', 'substructure': 'N/A'}, {'alert_name': 'iodine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

N-hydroxy-5-iodo-6-[[1-(4-methylphenyl)cyclopropyl]amino]pyridine-3-carboxamide
CID 145095861
5-ethyl-6-[(4-fluoro-1-phenyl-4-propylcyclohexyl)amino]-N-hydroxypyridine-3-carboxamide
CID 123600486
N-hydroxy-4-[(1-phenylcyclopropyl)amino]benzamide
CID 134492107
N-hydroxy-2-[[1-(hydroxymethyl)-4-phenylpiperidin-4-yl]amino]pyrimidine-5-carboxamide
CID 155469324
N-hydroxy-2-[[1-(methylcarbamoyl)-4-phenylpiperidin-4-yl]amino]pyrimidine-5-carboxamide
CID 118005584
benzyl 4-[[5-(hydroxycarbamoyl)pyrimidin-2-yl]amino]-4-phenylpiperidine-1-carboxylate
CID 118005857
2-[[1-(1-benzothiophen-2-yl)cyclopropyl]amino]-N-hydroxypyrimidine-5-carboxamide
CID 74763717
2-[(1-phenylcyclopropyl)amino]pyrimidin-5-ol
CID 139332383
2-[[1-[2-(3a,7a-dihydro-3H-indol-2-yl)acetyl]-4-phenylpiperidin-4-yl]amino]-N-hydroxypyrimidine-5-carboxamide
CID 123908891
ethyl 2-[(1-phenylcyclopropyl)amino]pyrimidine-5-carboxylate;molecular hydrogen
CID 145295764
3,4-dichloro-N-(1-phenylcyclopropyl)benzamide
CID 110444165
4-[(1-phenylcyclopropyl)amino]-6-(propanoylamino)pyridine-3-carboxamide
CID 123139569

Frequently Asked Questions

What is the IUPAC name of N-hydroxy-5-iodo-6-[(1-phenylcyclopropyl)amino]pyridine-3-carboxamide?
The IUPAC name of N-hydroxy-5-iodo-6-[(1-phenylcyclopropyl)amino]pyridine-3-carboxamide (CID 145095862) is N-hydroxy-5-iodo-6-[(1-phenylcyclopropyl)amino]pyridine-3-carboxamide.
What is the SMILES notation for N-hydroxy-5-iodo-6-[(1-phenylcyclopropyl)amino]pyridine-3-carboxamide?
The canonical SMILES for N-hydroxy-5-iodo-6-[(1-phenylcyclopropyl)amino]pyridine-3-carboxamide is O=C(NO)c1cnc(NC2(c3ccccc3)CC2)c(I)c1.
What is the InChIKey of N-hydroxy-5-iodo-6-[(1-phenylcyclopropyl)amino]pyridine-3-carboxamide?
The InChIKey is NGCMWDYSQMBVHO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14IN3O2/c16-12-8-10(14(20)19-21)9-17-13(12)18-15(6-7-15)11-4-2-1-3-5-11/h1-5,8-9,21H,6-7H2,(H,17,18)(H,19,20).
What are the key properties of N-hydroxy-5-iodo-6-[(1-phenylcyclopropyl)amino]pyridine-3-carboxamide?
N-hydroxy-5-iodo-6-[(1-phenylcyclopropyl)amino]pyridine-3-carboxamide has a molecular weight of 395.20 g/mol, XLogP of 2.91, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-hydroxy-5-iodo-6-[(1-phenylcyclopropyl)amino]pyridine-3-carboxamide is sourced from PubChem (CID 145095862), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).